N-[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-4-[(1-phenyl-1H-tetrazol-5-yl)thio]-2-naphthalenecarboxamide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C38H45N5O3S
Molecular Weight	651.861
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-4-[(1-phenyl-1H-tetrazol-5-yl)thio]-2-naphthalenecarboxamide

Structure Search

SMILES

CCC(C)(C)C1=CC(=C(OCCCCNC(=O)C2=C(O)C3=C(C=CC=C3)C(SC4=NN=NN4C5=CC=CC=C5)=C2)C=C1)C(C)(C)CC

InChI

InChIKey=CFRUNFQXALDGBM-UHFFFAOYSA-N

InChI=1S/C38H45N5O3S/c1-7-37(3,4)26-20-21-32(31(24-26)38(5,6)8-2)46-23-15-14-22-39-35(45)30-25-33(28-18-12-13-19-29(28)34(30)44)47-36-40-41-42-43(36)27-16-10-9-11-17-27/h9-13,16-21,24-25,44H,7-8,14-15,22-23H2,1-6H3,(H,39,45)

HIDE SMILES / InChI

Molecular Formula	C38H45N5O3S
Molecular Weight	651.861
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 18:47:16 GMT 2025` Edited by `admin` on `Tue Apr 01 18:47:16 GMT 2025`
Record UNII	748G7C9PAQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-Naphthalenecarboxamide, N-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-4-[(1-phenyl-1H-tetrazol-5-yl)thio]-

Preferred Name

English

N-[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-4-[(1-phenyl-1H-tetrazol-5-yl)thio]-2-naphthalenecarboxamide

Systematic Name

English

Code System Code Type Description

FDA UNII

748G7C9PAQ